Basic information
- Standard SMILES
CCCCCCCCNC(=O)Nc1ccc(S(=O)(=O)N2CCC(Nc3ccc(CC(OC)OC)cc3)CC2)cc1- InChIKey
CTIAMELUOZCGOR-UHFFFAOYSA-N- Molecular formula
- C30H46N4O5S
- Average molar mass
- 574.8 g/mol
- Monoisotopic mass
- 574.31889175
Names & identifiers
- Preferred name
- n-[4-({4-[4-(2,2-Dimethoxyethyl)anilino]-1-piperidinyl}sulfonyl)phenyl]-n'-octylurea
- IUPAC
- 1-[4-[4-[4-(2,2-dimethoxyethyl)anilino]piperidin-1-yl]sulfonylphenyl]-3-octylurea
Names & synonyms
SCHEMBL7093947CTIAMELUOZCGOR-UHFFFAOYSA-Nn-[4-({4-[4-(2,2-dimethoxyethyl)anilino]-1-piperidinyl}sulfonyl)phenyl]-n'-octylurea
Database identifiers
- PubChem CID
- 18173588
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 117 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 16
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 795
Related reactions
1 records
Compound notes
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